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5-isothiocyanato-3-propyl-isoquinoline

5-isothiocyanato-3-propyl-isoquinoline

Systemtic Name:5-isothiocyanato-3-propyl-isoquinoline
Openeye Name:5-isothiocyanato-3-propyl-isoquinoline
CAS Name:5-isothiocyanato-3-propylisoquinoline
IUPAC Name:5-isothiocyanato-3-propylisoquinoline
Traditional Name:5-isothiocyanato-3-propyl-isoquinoline
Formula: C13H12N2S
MolecularWeight: 228.31278
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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC=C2C=CC=C(C2=C1)N=C=S


Isomeric SMILES

CCCC1=NC=C2C=CC=C(C2=C1)N=C=S


InChI

InChI=1S/C13H12N2S/c1-2-4-11-7-12-10(8-14-11)5-3-6-13(12)15-9-16/h3,5-8H,2,4H2,1H3


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